1-ethyl-6-fluoro-4-methylquinolin-1-ium--4-methylbenzene-1-sulfonate (1/1)
Chemical Structure Depiction of
1-ethyl-6-fluoro-4-methylquinolin-1-ium--4-methylbenzene-1-sulfonate (1/1)
1-ethyl-6-fluoro-4-methylquinolin-1-ium--4-methylbenzene-1-sulfonate (1/1)
Compound characteristics
| Compound ID: | 0691-0006 |
| Compound Name: | 1-ethyl-6-fluoro-4-methylquinolin-1-ium--4-methylbenzene-1-sulfonate (1/1) |
| Molecular Weight: | 361.43 |
| Molecular Formula: | C12 H13 F N |
| Salt: | p-CH3C6H4SO3- |
| Smiles: | CC[n+]1ccc(C)c2cc(ccc12)F |
| Stereo: | ACHIRAL |
| logP: | 3.2462 |
| logD: | 3.2462 |
| logSw: | -3.0433 |
| Polar surface area: | 1.0554 |
| InChI Key: | BMYINICQZZELQT-UHFFFAOYSA-N |